Dipropyl (1-amino-2,2,2-trichloroethylidene)propanedioate
TL;DR: Dipropyl (1-amino-2,2,2-trichloroethylidene)propanedioate (CAS 22071-02-9) is a chemical compound with molecular formula C11H16Cl3NO4 and molecular weight 331.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dipropyl 2-(1-amino-2,2,2-trichloroethylidene)propanedioate
Also Known As: DivK1c_004856, CDS1_003816, BIM-0017589.P001, dipropyl (1-amino-2,2,2-trichloroethylidene)propanedioate, 1-Trichlormethyl-2,2-dicarbopropoxy-vinylamin
| Molecular Formula | C11H16Cl3NO4 |
|---|---|
| Molecular Weight | 331.01 g/mol |
| LogP | 2.4758 |
| Topological Polar Surface Area | 78.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 331.0145 |
| Heavy Atoms | 19 |
| Complexity | 341.44202 |
Chemical Identifiers
| CAS Number | 22071-02-9 |
|---|---|
| SMILES | CCCOC(=O)C(=C(C(Cl)(Cl)Cl)N)C(=O)OCCC |
Product Overview
Dipropyl (1-amino-2,2,2-trichloroethylidene)propanedioate (CAS 22071-02-9), with molecular formula C11H16Cl3NO4 and molecular weight 331.01 g/mol. IUPAC: dipropyl 2-(1-amino-2,2,2-trichloroethylidene)propanedioate.
Chemical Property Profile of Dipropyl (1-amino-2,2,2-trichloroethylidene)propanedioate
Property Insights of Dipropyl (1-amino-2,2,2-trichloroethylidene)propanedioate
The XLogP value of 2.4758 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dipropyl (1-amino-2,2,2-trichloroethylidene)propanedioate. The TPSA of 78.62 Ų falls within the moderate polarity range, balancing permeability and solubility for Dipropyl (1-amino-2,2,2-trichloroethylidene)propanedioate. Following Lipinski's Rule of Five, Dipropyl (1-amino-2,2,2-trichloroethylidene)propanedioate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dipropyl (1-amino-2,2,2-trichloroethylidene)propanedioate?
The CAS number of Dipropyl (1-amino-2,2,2-trichloroethylidene)propanedioate is 22071-02-9.
What is the molecular formula of Dipropyl (1-amino-2,2,2-trichloroethylidene)propanedioate?
The molecular formula of Dipropyl (1-amino-2,2,2-trichloroethylidene)propanedioate is C11H16Cl3NO4.
What is the molecular weight of Dipropyl (1-amino-2,2,2-trichloroethylidene)propanedioate?
The molecular weight of Dipropyl (1-amino-2,2,2-trichloroethylidene)propanedioate is 331.01 g/mol.
Where can I buy Dipropyl (1-amino-2,2,2-trichloroethylidene)propanedioate?
You can request a quote for Dipropyl (1-amino-2,2,2-trichloroethylidene)propanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dipropyl (1-amino-2,2,2-trichloroethylidene)propanedioate?
Yes, KEHONG BIO provides custom synthesis services for Dipropyl (1-amino-2,2,2-trichloroethylidene)propanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.